CHEBI:180330 - 8-propionyl caprylic acid

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ChEBI Name 8-propionyl caprylic acid
ChEBI ID CHEBI:180330
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C11H20O3
Net Charge 0
Average Mass 200.278
Monoisotopic Mass 200.14124
InChI InChI=1S/C11H20O3/c1-2-10(12)8-6-4-3-5-7-9-11(13)14/h2-9H2,1H3,(H,13,14)
InChIKey KUPZGNQJONLIRP-UHFFFAOYSA-N
SMILES O=C(CCCCCCCC(O)=O)CC
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
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ChEBI Ontology
Outgoing 8-propionyl caprylic acid (CHEBI:180330) is a medium-chain fatty acid (CHEBI:59554)
IUPAC Name
9-oxoundecanoic acid
Manual Xrefs Databases
4446113 ChemSpider
LMFA01060037 LIPID MAPS
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